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	hartrees
Energy at 0K	-1058.603998
Energy at 298.15K	-1058.605130
HF Energy	-1058.603998
Nuclear repulsion energy	197.792807

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	1152	1028	10.54
2	A	708	631	18.12
3	A	353	315	1.40
4	A	123	109	0.34
5	B	728	649	75.72
6	B	450	402	15.26

Atom	x (Å)	y (Å)	z (Å)
O1	0.348	0.594	0.871
O2	-0.348	-0.594	0.871
Cl3	-0.348	1.763	-0.410
Cl4	0.348	-1.763	-0.410

	O1	O2	Cl3	Cl4
O1		1.3767	1.8692	2.6830
O2	1.3767		2.6830	1.8692
Cl3	1.8692	2.6830		3.5948
Cl4	2.6830	1.8692	3.5948

Number	Element	Mulliken
1	O	0.059
2	O	0.059
3	Cl	-0.059
4	Cl	-0.059

All results from a given calculation for ClOOCl (Dichlorine dioxide)

using model chemistry: B3LYP/STO-3G

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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	x	y	z	Total
	0.000	0.000	0.955	0.955
CHELPG
AIM
ESP

	x	y	z
x	0.817	-1.103	0.000
y	-1.103	6.179	0.000
z	0.000	0.000	2.032

<r²>	155.696
(<r²>)^1/2	12.478